CAS 741736-98-1 2-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride (HCID 57445256)

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Basic information

CAS: 741736-98-1
Standard SMILES: Cl.FC(F)(F)c1ccc2c(n1)CCNC2
InChIKey: CZBDSVSNEMGVSY-UHFFFAOYSA-N
Molecular formula: C9H10ClF3N2
Average molar mass: 238.64 g/mol
Monoisotopic mass: 238.04846066

Names & identifiers

Preferred name: 2-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride
IUPAC: 2-(trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine;hydrochloride
English name: 2-(trifluoroMethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride
Molecular formula: C9H10ClF3N2
Molecular weight: 238.64

Names & synonyms

2-(trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochlorideRefChem:462523874-319-6741736-98-1MFCD205287172-(trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine;hydrochloride2-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine HClSCHEMBL3881128DTXSID707265232-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridinehydrochlorideAKOS016015149BS-49946

Show more names

DB-302015CS-0157262EN300-9342232Z30692815992-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine, hydrochloride2-trifluoromethyl-5,6,7,8-tetrahydro-[1,6]naphthyridine hydrochloride2-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine--hydrogen chloride (1/1)

Database identifiers

CAS: 741736-98-1
PubChem CID: 57445256
DTXSID: DTXSID70726523
EC Number: 874-319-6

Properties

Computed structural properties

Topological polar surface area: 24.9 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 0
Heavy atoms: 15
Formal charge: 0
Complexity: 205

Physicochemical properties

storage temp.: 2 · 2-8°C(protect from light)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.